3-(3-fluoranylbenzo[b][1]benzothiepin-5-yl)-N,N-dimethyl-prop-2-yn-1-amine

Systemtic Name: 3-(3-fluoranylbenzo[b][1]benzothiepin-5-yl)-N,N-dimethyl-prop-2-yn-1-amine Openeye Name: 3-(3-fluorobenzo[b][1]benzothiepin-5-yl)-N,N-dimethyl-prop-2-yn-1-amine CAS Name: 3-(3-fluoro-5-benzo[b][1]benzothiepinyl)-N,N-dimethyl-2-propyn-1-amine IUPAC Name: 3-(3-fluorobenzo[b][1]benzothiepin-5-yl)-N,N-dimethylprop-2-yn-1-amine Traditional Name: 3-(3-fluorobenzo[b][1]benzothiepin-5-yl)prop-2-ynyl-dimethyl-amine Formula: C19H16FNS MolecularWeight: 309.400443

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC#CC1=CC2=CC=CC=C2SC3=C1C=C(C=C3)F

Isomeric SMILES

CN(C)CC#CC1=CC2=CC=CC=C2SC3=C1C=C(C=C3)F

InChI

InChI=1S/C19H16FNS/c1-21(2)11-5-7-14-12-15-6-3-4-8-18(15)22-19-10-9-16(20)13-17(14)19/h3-4,6,8-10,12-13H,11H2,1-2H3